input word = C00037254

Metabolite InformationStructural formula
Name Heliotropinone B
(+)-Heliotropinone B
Formula C18H22O4
Mw 302.15180919
CAS RN 381723-53-1
C_ID C00037254 ,
InChIKey GFWSTYAKNHELSQ-UHFFFAOYNA-N
InChICode InChI=1S/C18H20O4/c1-10-6-5-7-18(2)9-12-11(8-13(10)18)14(19)16(21-3)17(22-4)15(12)20/h5,7,13H,1,6,8-9H2,2-4H3/t13-,18+/m1/s1
SMILES C1(=C(C(=O)C2=C(C1=O)C[C@H]1[C@](C2)(C=CCC1=C)C)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeHeliotropium ovalifolium Ref.
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OrganismHeliotropium ovalifolium
ReferenceGuntern,Phytochem.,58,(2001),631